CHEMICAL AND PHYSICAL PROPERTIES
| Physical Description | Liquid |
|---|---|
| Boiling Point | 373.00 to 374.00 °C. @ 760.00 mm Hg |
| Melting Point | -35 °C |
| LogP | 6.82 |
| Collision Cross Section | 187.2 Ų [M+H]+ [CCS Type: DT, Method: stepped-field] |
| Kovats Retention Index | 2071 2087 2069 2070 2061 2066.9 2078 2092 2100 2077 2072 2083 2070 2082 2087 2070 2067 2090 2078 2100 2100 2073 2073 |
COMPUTED DESCRIPTORS
| Molecular Weight | 294.5 g/mol |
|---|---|
| XLogP3 | 6.9 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 15 |
| Exact Mass | 294.255880323 g/mol |
| Monoisotopic Mass | 294.255880323 g/mol |
| Topological Polar Surface Area | 26.3 Ų |
| Heavy Atom Count | 21 |
| Formal Charge | 0 |
| Complexity | 279 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
PRODUCT INTRODUCTION
description
Methyl linoleate is a fatty acid methyl ester of linoleic acid. It has been isolated from Neolitsea daibuensis. It has a role as a plant metabolite. It is functionally related to a linoleic acid.